Input 01-propagators.05-etrs_chebyshev.inp
Commits >
Commit eddb1a976bbe1f1b2f6bb64793dd776e6572a2b5 >
Run foss_cmake: [foss2022a-mpi, foss-full-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
Energy [step 0] | -1.060686608766763e+01 | -1.060686608766761e+01 | 1.060000000000000e-13 | -1.598721155460225e-14 | PASS |
Energy [step 20] | -1.060638479805074e+01 | -1.060638479805075e+01 | 1.060000000000000e-13 | 5.329070518200751e-15 | PASS |
Multipoles [step 0] | -3.169236113776883e-16 | 0.000000000000000e+00 | 1.000000000000000e-14 | -3.169236113776883e-16 | PASS |
Multipoles [step 20] | -1.269180738429581e-01 | -1.269180738429604e-01 | 1.000000000000000e-14 | 2.275957200481571e-15 | PASS |
Forces [step 0] | 8.537673799433509e-02 | 8.537673799433310e-02 | 1.000000000000000e-14 | 1.998401444325282e-15 | PASS |
Forces [step 20] | 7.982464236112952e-02 | 7.982464236112929e-02 | 1.000000000000000e-14 | 2.220446049250313e-16 | PASS |